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  • 4-[(2-pyrrolidin-1-ylethyl)carbamoyl]benzeneboronic acid hydrochloride

  • 4-[(2-pyrrolidin-1-ylethyl)carbamoyl]benzeneboronic acid hydrochloride

    Catalog Number
    ACMA00015119
    Product Name
    4-[(2-pyrrolidin-1-ylethyl)carbamoyl]benzeneboronic acid hydrochloride
    Category
    Salt
    IUPAC Name
    [4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]boronic acid;hydrochloride
    Molecular Weight
    298.57g/mol
    Molecular Formula
    C13H20BClN2O3
    Canonical SMILES
    B(C1=CC=C(C=C1)C(=O)NCCN2CCCC2)(O)O.Cl
    InChI
    InChI=1S/C13H19BN2O3.ClH/c17-13(15-7-10-16-8-1-2-9-16)11-3-5-12(6-4-11)14(18)19;/h3-6,18-19H,1-2,7-10H2,(H,15,17);1H
    InChI Key
    WQGZMXJVRQNVRB-UHFFFAOYSA-N
    Complexity
    288
    Covalently-Bonded Unit Count
    2
    Exact Mass
    298.12555g/mol
    Formal Charge
    0
    Heavy Atom Count
    20
    Monoisotopic Mass
    298.12555g/mol
    Rotatable Bond Count
    5
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